4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=35.94378879429234 stress="-4.195009200046065 0.9144321818305149 0.5897181876231428 0.9144321818305149 -5.194919137990765 -0.2081309408581907 0.5897181876231428 -0.2081309408581907 -5.424171657098356" pbc="T T T" Fe 0.27559981 -0.28678287 0.21736445 -52.79292809 37.62527576 14.05682868 P 1.28604778 1.70384132 -0.20775377 41.19945137 -45.85846611 12.36628150 P 1.23214964 0.00041025 1.75551247 24.81213762 15.68071830 -18.21259001 Fe -0.14555376 1.49188881 1.56482696 -13.21866090 -7.44752794 -8.21052017